ChemSpider 2D Image | 3-[(2-Ethylhexyl)oxy]-1-propanethiol | C11H24OS

3-[(2-Ethylhexyl)oxy]-1-propanethiol

  • Molecular FormulaC11H24OS
  • Average mass204.373 Da
  • Monoisotopic mass204.154785 Da
  • ChemSpider ID35588932

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1-Propanethiol, 3-[(2-ethylhexyl)oxy]- [ACD/Index Name]
3-[(2-Ethylhexyl)oxy]-1-propanethiol [ACD/IUPAC Name]
3-[(2-Éthylhexyl)oxy]-1-propanethiol [French] [ACD/IUPAC Name]
3-[(2-Ethylhexyl)oxy]-1-propanthiol [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 0.9±0.1 g/cm3
Boiling Point: 264.6±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.2±3.0 kJ/mol
Flash Point: 113.8±22.6 °C
Index of Refraction: 1.455
Molar Refractivity: 62.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.41
ACD/LogD (pH 5.5): 4.49
ACD/BCF (pH 5.5): 1520.99
ACD/KOC (pH 5.5): 6597.23
ACD/LogD (pH 7.4): 4.49
ACD/BCF (pH 7.4): 1518.58
ACD/KOC (pH 7.4): 6586.76
Polar Surface Area: 48 Å2
Polarizability: 24.8±0.5 10-24cm3
Surface Tension: 29.6±3.0 dyne/cm
Molar Volume: 230.9±3.0 cm3

Click to predict properties on the Chemicalize site


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